2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol

C9H23NO4Si — CID 58827754

IUPAC2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol
SMILESCO[Si](CO)(CCCN(C)CCO)OC
InChIInChI=1S/C9H23NO4Si/c1-10(6-7-11)5-4-8-15(9-12,13-2)14-3/h11-12H,4-9H2,1-3H3
InChIKeyOBTRGVOTXPHLJF-UHFFFAOYSA-N
MW237.37 g/mol
LogP-0.43
Rot. Bonds9

About 2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol

2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol (PubChem CID 58827754) has the molecular formula C9H23NO4Si and a molecular weight of 237.37 g/mol. Its IUPAC name is 2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol.

Molecular Properties

Compound Name2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol
PubChem CID58827754
Molecular FormulaC9H23NO4Si
Molecular Weight237.37 g/mol
Exact Mass237.14
IUPAC Name2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol
SMILESCO[Si](CO)(CCCN(C)CCO)OC
InChIInChI=1S/C9H23NO4Si/c1-10(6-7-11)5-4-8-15(9-12,13-2)14-3/h11-12H,4-9H2,1-3H3
InChIKeyOBTRGVOTXPHLJF-UHFFFAOYSA-N
XLogP-0.43
TPSA62.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.37
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol?
The IUPAC name of 2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol (CID 58827754) is 2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol.
What is the SMILES notation for 2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol?
The canonical SMILES for 2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol is CO[Si](CO)(CCCN(C)CCO)OC.
What is the InChIKey of 2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol?
The InChIKey is OBTRGVOTXPHLJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23NO4Si/c1-10(6-7-11)5-4-8-15(9-12,13-2)14-3/h11-12H,4-9H2,1-3H3.
What are the key properties of 2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol?
2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol has a molecular weight of 237.37 g/mol, XLogP of -0.43, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[hydroxymethyl(dimethoxy)silyl]propyl-methylamino]ethanol is sourced from PubChem (CID 58827754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).